SCHEMBL154346

SCHEMBL154346

CN(c1cccc(C#N)c1)[Si](C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 1/20 0.41
KCNA5 P22460 1/20 0.41
CLK4 Q9HAZ1 3/20 0.41
NOTUM Q6P988 1/20 0.39
MAOB P27338 1/20 0.39
ENPP2 Q13822 1/20 0.39
MAPK14 Q16539 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 2/20 0.38
CYP3A4 P08684 2/20 0.38
TSHR P16473 2/20 0.38
MEN1 O00255 1/20 0.38
LMNA P02545 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
KMT2A Q03164 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GSK3B P49841 1/20 0.38
GRM5 P41594 3/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL129309 0.83 KCNN4 (0.42) KCNN4KCNA5CLK4NOTUMMAOB
SCHEMBL151270 0.80 ALDH1A1 (0.48) KCNN4KCNA5CLK4MAOBENPP2
SCHEMBL130127 0.76 CYP2A6 (0.44) NOTUMENPP2ALDH1A1TSHRLMNA
SCHEMBL12060550 0.76 KCNA5 (0.49) KCNN4KCNA5CLK4ENPP2ALDH1A1
SCHEMBL21649599 0.76 KCNN4 (0.42) KCNN4KCNA5CLK4MAOBENPP2
SCHEMBL8979326 0.74 KCNN4 (0.41) KCNN4KCNA5CLK4MAOBENPP2
SCHEMBL15018261 0.74 KCNN4 (0.44) KCNN4KCNA5CLK4MAOBENPP2
SCHEMBL14034729 0.74 KCNN4 (0.48) KCNN4KCNA5CLK4ENPP2TSHR
SCHEMBL150221 0.74 MEP1A (0.48) ALDH1A1TSHRMEN1KMT2AGSK3B
SCHEMBL12574227 0.73 MAPK14 (0.46) KCNN4KCNA5NOTUMENPP2MAPK14

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8735494-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2014-05-27 US disclosed
US-20130085227-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2013-04-04 US disclosed
US-8344066-B2 Polymers functionalized with nitrile compounds containing a protected amino group BRIDGESTONE CORPORATION (JP) 2013-01-01 US disclosed
US-20120059112-A1 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS COMTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2012-03-08 US disclosed
EP-2382240-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP Bridgestone Corporation (JP) 2011-11-02 EP disclosed
WO-2010085622-A9 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-12-23 WO disclosed
WO-2010085622-A2 POLYMERS FUNCTIONALIZED WITH NITRILE COMPOUNDS CONTAINING A PROTECTED AMINO GROUP BRIDGESTONE CORPORATION (JP) 2010-07-29 WO disclosed